Information card for entry 2242542

Structure parameters

• Chemical name: Germanium titanium tetraoxide
• Formula: Ge1.14 O4 Ti0.86
• Calculated formula: Ge1.14 O4 Ti0.86
• Title of publication: Ge~0.57~Ti~0.43~O~2~: a new high-pressure material with rutile-type crystal structure
• Authors of publication: Stoyanov, Emil; Leinenweber, Kurt; Groy, Thomas L.; Malik, Abds-Sami
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 7
• Pages of publication: 1010 - 1012
• a: 4.493 ± 0.002 Å
• b: 4.493 ± 0.002 Å
• c: 2.9121 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 58.79 ± 0.05 ų
• Cell temperature: 298 ± 0.1 K
• Ambient diffraction temperature: 298 ± 0.1 K
• Number of distinct elements: 3
• Space group number: 136
• Hermann-Mauguin space group symbol: P 42/m n m
• Hall space group symbol: -P 4n 2n
• Residual factor for all reflections: 0.0181
• Residual factor for significantly intense reflections: 0.0178
• Weighted residual factors for significantly intense reflections: 0.0495
• Weighted residual factors for all reflections included in the refinement: 0.0496
• Goodness-of-fit parameter for all reflections included in the refinement: 1.204
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes